(Z)-2-nitroethenesulfonamide

C2H4N2O4S — CID 59716481

IUPAC(Z)-2-nitroethenesulfonamide
SMILESNS(=O)(=O)/C=C\[N+](=O)[O-]
InChIInChI=1S/C2H4N2O4S/c3-9(7,8)2-1-4(5)6/h1-2H,(H2,3,7,8)/b2-1-
InChIKeyXNAFCEPGZXSLSD-UPHRSURJSA-N
MW152.13 g/mol
LogP-0.98
Rot. Bonds2

About (Z)-2-nitroethenesulfonamide

(Z)-2-nitroethenesulfonamide (PubChem CID 59716481) has the molecular formula C2H4N2O4S and a molecular weight of 152.13 g/mol. Its IUPAC name is (Z)-2-nitroethenesulfonamide.

Molecular Properties

Compound Name(Z)-2-nitroethenesulfonamide
PubChem CID59716481
Molecular FormulaC2H4N2O4S
Molecular Weight152.13 g/mol
Exact Mass151.99
IUPAC Name(Z)-2-nitroethenesulfonamide
SMILESNS(=O)(=O)/C=C\[N+](=O)[O-]
InChIInChI=1S/C2H4N2O4S/c3-9(7,8)2-1-4(5)6/h1-2H,(H2,3,7,8)/b2-1-
InChIKeyXNAFCEPGZXSLSD-UPHRSURJSA-N
XLogP-0.98
TPSA103.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.13
LogP ≤ 5-0.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (Z)-2-nitroethenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1E,3E,5E,7E)-8-nitroocta-1,3,5,7-tetraen-1-amine
CID 102095287
1,5-dinitropenta-1,4-diene
CID 174846180
tetrasilver;tetranitrate
CID 172745321
3-aminoprop-1-ene-1-sulfonamide
CID 87526420
1-nitrobuta-1,3-diene
CID 54506011
1-(2-nitroethenyl)-4-[4-(2-nitroethenyl)phenyl]sulfonylbenzene
CID 87998421
1-[(E)-2-nitroethenyl]-4-[4-[(E)-2-nitroethenyl]phenyl]sulfonylbenzene
CID 173225544
methyl 4-(2-nitroethenyl)benzenesulfonate
CID 54355882
3-sulfamoylprop-2-enamide
CID 142050789
azane;cerium;cobalt;nitric acid;sulfamic acid
CID 174884771
dimethyl(2-nitroethenyl)sulfanium
CID 172784441
N-hydrazinylidenenitramide
CID 71343524

Frequently Asked Questions

What is the IUPAC name of (Z)-2-nitroethenesulfonamide?
The IUPAC name of (Z)-2-nitroethenesulfonamide (CID 59716481) is (Z)-2-nitroethenesulfonamide.
What is the SMILES notation for (Z)-2-nitroethenesulfonamide?
The canonical SMILES for (Z)-2-nitroethenesulfonamide is NS(=O)(=O)/C=C\[N+](=O)[O-].
What is the InChIKey of (Z)-2-nitroethenesulfonamide?
The InChIKey is XNAFCEPGZXSLSD-UPHRSURJSA-N. The full InChI is InChI=1S/C2H4N2O4S/c3-9(7,8)2-1-4(5)6/h1-2H,(H2,3,7,8)/b2-1-.
What are the key properties of (Z)-2-nitroethenesulfonamide?
(Z)-2-nitroethenesulfonamide has a molecular weight of 152.13 g/mol, XLogP of -0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-nitroethenesulfonamide is sourced from PubChem (CID 59716481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).